5-(3-bromophenyl)-2-[[ethyl-(phenylmethyl)amino]methyl]-4-methyl-1,2,4-triazole-3-thione

Systemtic Name: 5-(3-bromophenyl)-2-[[ethyl-(phenylmethyl)amino]methyl]-4-methyl-1,2,4-triazole-3-thione Openeye Name: 2-[[benzyl(ethyl)amino]methyl]-5-(3-bromophenyl)-4-methyl-1,2,4-triazole-3-thione CAS Name: 5-(3-bromophenyl)-2-[[ethyl-(phenylmethyl)amino]methyl]-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[benzyl(ethyl)amino]methyl]-5-(3-bromophenyl)-4-methyl-1,2,4-triazole-3-thione Traditional Name: 2-[[benzyl(ethyl)amino]methyl]-5-(3-bromophenyl)-4-methyl-1,2,4-triazole-3-thione Formula: C19H21BrN4S MolecularWeight: 417.36584

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)CN2C(=S)N(C(=N2)C3=CC(=CC=C3)Br)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)CN2C(=S)N(C(=N2)C3=CC(=CC=C3)Br)C

InChI

InChI=1S/C19H21BrN4S/c1-3-23(13-15-8-5-4-6-9-15)14-24-19(25)22(2)18(21-24)16-10-7-11-17(20)12-16/h4-12H,3,13-14H2,1-2H3